Applied Statistics. Multivariate Analysis - part II. Troels C. Petersen (NBI) Statistics is merely a quantization of common sense 1
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1 Applied Statistics Multivariate Analysis - part II Troels C. Petersen (NBI) Statistics is merely a quantization of common sense 1
2 Fisher Discriminant You want to separate two types/classes (A and B) of events using several measurements. Q: How to combine the variables? A: Use the Fisher Discriminant: F = w 0 + ~w ~x Q: How to choose the values of w? A: Inverting the covariance matrices: ~w =( A + B ) 1 (~µ A ~µ B ) This can be calculated analytically, and incorporates the linear correlations into the separation capability. 2
3 Fisher Discriminant The details of the formula are outlined below: For each input variable (x), you calculate the mean (µ), and form a vector of these. ~w =( A + B ) 1 (~µ A ~µ B ) Using the input variables (x), you calculate the covariance matrix (Σ) for each species (A/B), add these and invert. Given weights (w), you take your input variables (x) and combine them linearly as follows: F = w 0 + ~w ~x F is what you base your decision on. 3
4 Non-linear MVAs While the Fisher Discriminant uses all separations and linear correlations, it does not perform optimally, when there are non-linear correlations present: If the PDFs of signal and background are known, then one can use a likelihood. But this is very rarely the case, and therefore more tough methods are needed... 4
5 Neural Networks (NN) In machine learning and related fields, artificial neural networks (ANNs) are computational models inspired by an animal's central nervous systems (in particular the brain) which is capable of machine learning as well as pattern recognition. Neural networks have been used to solve a wide variety of tasks that are hard to solve using ordinary rule-based programming, including computer vision and speech recognition. [Wikipedia, Introduction to Artificial Neural Network] 5
6 Neural Networks Neural Networks combine the input variables using a activation function s(x) to assign, if the variable indicates signal or background. s(x) = 1 1+e a(x x 0) The simplest is a single layer perceptron: t(x) =s a 0 + X a i x i This can be generalized to a multilayer perceptron: t(x) =s a i + X a i h i (x) h i (x) =s w i0 + X w ij x j Activation function can be any sigmoid function. 6
7 Boosted Decision Trees (BDT) Decision tree learning uses a decision tree as a predictive model which maps observations about an item to conclusions about the item's target value. It is one of the predictive modelling approaches used in statistics, data mining and machine learning. [Wikipedia, Introduction to Decision Tree Learning] 7
8 Boosted Decision Trees (BDT) This is an unrelated example of a decision tree from the real world. 8
9 Boosted Decision Trees A decision tree divides the parameter space, starting with the maximal separation. In the end each part has a probability of being signal or background. Works in 95+% of all problems! Fully uses non-linear correlations. But BDTs require a lot of data for training, and is sensitive to overtraining (see next slide). Overtraining can be reduced by limiting the number of nodes and number of trees. 9
10 Boosting... There is no reason, why you can not have more trees. Each tree is a simple classifier, but many can be combined! To avoid N identical trees, one assigns a higher weight to events that are hard to classify, i.e. boosting: First classifier Boost weight Parameters in event N Individual tree 10
11 Test for overtraining In order to test for overtraining, half the sample is used for training, the other for testing: 11
12 TMVA - MVA in ROOT The main parameters to consider in setting up the training in TMVA are: Generally: Definition of signal and background (selection and/or separate files) Variables to use ( vardict ) Which methods to use ( factory.bookmethod, i.e. Fisher, NN, BDT, etc.) Settings/options (see below) Boosted Decision Tree: Transformation of variables? (i.e. Principle Component Analysis (PCA)) Number of trees ( NTrees ). Maximum depth of trees ( MaxDepth ). Neural Network: Transformation of variables? (i.e. Principle Component Analysis (PCA)). Number of cycles ( NCycles, i.e. number of training rounds). Number of hidden layers ( N, i.e. N+1 or N+1, N ). 12
13 Method s (dis-)advantages 13
14 Example of method comparison Left figure shows the distribution of signal and background used for test. Right figure shows the resulting separation using various MVA methods. The theoretical limit is known from the Neyman-Pearson lemma using the (known/correct) PDFs in a likelihood. In all fairness, this is a case that is great for the BDT... 14
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